1,3,6,8-Tetranitropyrene

Base Information

• Chemical Name: 1,3,6,8-Tetranitropyrene
• CAS No.: 28767-61-5
• Molecular Formula: C16H6 N4 O8
• Molecular Weight: 382.246
• Hs Code.: 2904209090
• European Community (EC) Number: 684-180-1
• NSC Number: 156560
• UNII: XT7XK9XXR8
• DSSTox Substance ID: DTXSID6075223
• Nikkaji Number: J51.262A
• Wikidata: Q82003235
• ChEMBL ID: CHEMBL354712
• Mol file: 28767-61-5.mol

Synonyms:1,3,6,8-TETRANITROPYRENE;Pyrene, 1,3,6,8-tetranitro-;28767-61-5;XT7XK9XXR8;NSC 156560;BRN 2315192;C16H6N4O8;NSC-156560;NSC156560;UNII-XT7XK9XXR8;1,3,6,8-Tetranitro-pyrene;CHEMBL354712;DTXSID6075223;C16-H6-N4-O8;LS-129460

Chemical Property of 1,3,6,8-Tetranitropyrene

Chemical Property:

• Vapor Pressure: 6.9E-14mmHg at 25°C
• Refractive Index: 1.6300 (estimate)
• Boiling Point: 603.8°C at 760 mmHg
• Flash Point: 302.8°C
• PSA: 183.28000
• Density: 1.825g/cm³
• LogP: 6.30960
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 382.01856316
• Heavy Atom Count: 28
• Complexity: 593

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C=CC4=C(C=C(C1=C43)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 1,3,6,8-Tetranitropyrene

There total 4 articles about 1,3,6,8-Tetranitropyrene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

pyrene (129-00-0) → 1,3,6,8-tetranitropyrene (28767-61-5)

Guidance literature:

With nitric acid; anfangs unter Kuehlung, zuletzt bei 80grad;

Reference yield:

→ 1,3,6,8-tetranitropyrene (28767-61-5)

Guidance literature:

With nitric acid;

Reference yield:

pyrene (129-00-0) → 1,3,6,8-tetranitropyrene (28767-61-5)

Guidance literature:

anfangs unter Kuehlung, zuletzt bei 80grad;

upstream raw materials:

pyrene

Downstream raw materials:

naphthalene-1,4,5,8-tetracarboxylic acid

1,4,5,8-naphthalenetetracarboxylic dianhydride

1,3,6,8-tetrachloropyrene

3-nitro-pyrene-1,6-dione